COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK788554
Chemical Name: [(4-cyano-1-phenyl-5,6,7,8-tetrahydroisoquinolin-3-yl)sulfanyl]aceticacid
Smiles: N#Cc1c(SCC(=O)O)nc(c2c1CCCC2)c1ccccc1

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Molecular Weight: 324.4
Empirical Formula: C18H16N2O2S

Physical State: Dry powder
Available Amount: 256 mg

Lipinsky:
logP: 4.336
Rotatable bonds: 4
H-donors: 1
H-acceptors: 2
PSA: 99
Number of rings: 3

     

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